SCHEMBL7657154

SCHEMBL7657154

NC(=O)c1ccc(NC(=S)NCc2ccccc2F)cc1

nearest known ligand 0.71

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 3/20 0.71
MEN1 O00255 5/20 0.67
KMT2A Q03164 5/20 0.67
LMNA P02545 4/20 0.67
SMN1; SMN2 Q16637 3/20 0.67
MAPT P10636 3/20 0.67
PKM P14618 1/20 0.67
CRHBP P24387 1/20 0.67
CRHR2 Q13324 1/20 0.67
ALDH1A1 P00352 4/20 0.58
GAA P10253 2/20 0.58
KDM4E B2RXH2 1/20 0.56
HTT P42858 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.51
NAMPT P43490 2/20 0.50
MAOB P27338 1/20 0.49
PARP15 Q460N3 1/20 0.49
PARP14 Q460N5 1/20 0.49
PARP10 Q53GL7 1/20 0.49

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6819592 0.87 MAPT (0.70) HDAC1MEN1KMT2ALMNASMN1; SMN2
SCHEMBL7662583 0.84 ALDH1A1 (0.67) HDAC1MEN1KMT2ALMNASMN1; SMN2
SCHEMBL7657162 0.83 MEN1 (0.74) HDAC1MEN1KMT2ALMNASMN1; SMN2
SCHEMBL28408166 0.83 HDAC1 (1.00) HDAC1MEN1KMT2ALMNASMN1; SMN2
SCHEMBL7692027 0.81 ALDH1A1 (0.69) HDAC1MEN1KMT2ALMNASMN1; SMN2
SCHEMBL6816286 0.81 KMT2A (0.54) HDAC1MEN1KMT2ALMNASMN1; SMN2
SCHEMBL6816841 0.81 MAOB (0.69) MEN1KMT2ASMN1; SMN2MAPTALDH1A1
SCHEMBL7657194 0.78 ALDH1A1 (0.66) HDAC1MEN1KMT2ALMNASMN1; SMN2
SCHEMBL6815180 0.78 KDM4E (0.54) HDAC1MEN1KMT2ALMNASMN1; SMN2
SCHEMBL7666784 0.78 ALDH1A1 (0.64) HDAC1MEN1KMT2ALMNASMN1; SMN2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6407249-B1 COMPOUNDS CONTAINING FURAN RING STRUCTURE AMERICAN HOME PRODUCTS CORPORATION 2002-06-18 US disclosed
US-6335350-B1 VARICELLA-ZOSTER, HUMAN CYTOMEGALO, EPSTEIN-BARR AND KAPOSI HERPESVIRUS TREATMENT AMERICAN HOME PRODUCTS CORPORATION 2002-01-01 US disclosed
US-6207715-B1 USEFUL IN THERAPY OF DISEASES ASSOCIATED WITH HERPES VIRUSES INCLUDING HUMAN CYTOMEGALOVIRUS, HERPES SIMPLEX VIRUSES, EPSTEIN-BARR VIRUS, VARICELLA-ZOSTER VIRUS, HUMAN HERPESVIRUSES-6 AND -7, AND KAPOSI HERPES VIRUS AMERICAN HOME PRODUCTS CORPORATION 2001-03-27 US disclosed
US-6201013-B1 INOSINE MONOPHOSPHATE DEHYDROGENASE (IMPDH) INHIBITOR; SIDE EFFECT REDUCTION, NON-DRUG RESISTANT AMERICAN HOME PRODUCTS CORPORATION 2001-03-13 US disclosed
US-6166028-A Diaminopuridine-containing thiourea inhibitors of herpes viruses AMERICAN HOME PRODUCTS CORPORATION (US) 2000-12-26 US disclosed